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Searched refs:NumPartialCharges (Results 1 – 8 of 8) sorted by relevance

/dports/science/openbabel/openbabel-3.1.1/include/openbabel/
H A Dgeneric.h1164 int NumPartialCharges() in NumPartialCharges() function
/dports/science/openbabel/openbabel-3.1.1/scripts/perl/
H A DOpenBabel.pm2264 *NumPartialCharges = *Chemistry::OpenBabelc::OBPcharge_NumPartialCharges;
H A Dopenbabel-perl.cpp10517 …rg1 = reinterpret_cast< OpenBabel::OBPcharge * >(argp1); result = (int)(arg1)->NumPartialCharges(); in XS()
/dports/science/openbabel/openbabel-3.1.1/scripts/python/openbabel/
H A Dopenbabel.py1557 OBPcharge.NumPartialCharges = new_instancemethod(_openbabel.OBPcharge_NumPartialCharges, None, OBPc…
H A Dopenbabel-python.cpp21172 …rg1 = reinterpret_cast< OpenBabel::OBPcharge * >(argp1); result = (int)(arg1)->NumPartialCharges(); in _wrap_OBPcharge_NumPartialCharges()
/dports/science/openbabel/openbabel-3.1.1/scripts/csharp/
H A Dopenbabel-csharp.cpp7723 result = (int)(arg1)->NumPartialCharges(); jresult = result; return jresult; } in CSharp_OpenBabel_OBPcharge_NumPartialCharges()
/dports/science/openbabel/openbabel-3.1.1/scripts/java/
H A Dopenbabel-java.cpp3880 …arg1 = *(OpenBabel::OBPcharge **)&jarg1; result = (int)(arg1)->NumPartialCharges(); jresult = (ji… in Java_org_openbabel_openbabel_1javaJNI_OBPcharge_1NumPartialCharges()
/dports/science/openbabel/openbabel-3.1.1/scripts/ruby/
H A Dopenbabel-ruby.cpp21184 …rg1 = reinterpret_cast< OpenBabel::OBPcharge * >(argp1); result = (int)(arg1)->NumPartialCharges(); in _wrap_OBPcharge_num_partial_charges()